bis(2-methanidyl-2-methylpropane);bis(2-methylpropane);bis(yttrium)

C18H40Y2-4 — CID 165071362

IUPACbis(2-methanidyl-2-methylpropane);bis(2-methylpropane);bis(yttrium)
SMILESC[C-](C)C.C[C-](C)C.[CH2-]C(C)(C)C.[CH2-]C(C)(C)C.[Y].[Y]
InChIInChI=1S/2C5H11.2C4H9.2Y/c2*1-5(2,3)4;2*1-4(2)3;;/h2*1H2,2-4H3;2*1-3H3;;/q4*-1;;
InChIKeySJKCPHYJNYGIET-UHFFFAOYSA-N
MW434.33 g/mol
LogP6.97
Rot. Bonds

About bis(2-methanidyl-2-methylpropane);bis(2-methylpropane);bis(yttrium)

bis(2-methanidyl-2-methylpropane);bis(2-methylpropane);bis(yttrium) (PubChem CID 165071362) has the molecular formula C18H40Y2-4 and a molecular weight of 434.33 g/mol. Its IUPAC name is bis(2-methanidyl-2-methylpropane);bis(2-methylpropane);bis(yttrium).

Molecular Properties

Compound Namebis(2-methanidyl-2-methylpropane);bis(2-methylpropane);bis(yttrium)
PubChem CID165071362
Molecular FormulaC18H40Y2-4
Molecular Weight434.33 g/mol
Exact Mass434.13
IUPAC Namebis(2-methanidyl-2-methylpropane);bis(2-methylpropane);bis(yttrium)
SMILESC[C-](C)C.C[C-](C)C.[CH2-]C(C)(C)C.[CH2-]C(C)(C)C.[Y].[Y]
InChIInChI=1S/2C5H11.2C4H9.2Y/c2*1-5(2,3)4;2*1-4(2)3;;/h2*1H2,2-4H3;2*1-3H3;;/q4*-1;;
InChIKeySJKCPHYJNYGIET-UHFFFAOYSA-N
XLogP6.97
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms20
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500434.33
LogP ≤ 56.97
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Carbo_cation/anion', 'substructure': 'N/A'}

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Related Compounds

2-methanidyl-2-methylpropane;rhenium;yttrium
CID 58594735
dilithium;2-methanidyl-2-methylpropane
CID 14120101
2-methanidyl-2-methylpropane;palladium
CID 163183764
lithium 2-methanidyl-2-methylpropane
CID 10898631
manganese;2-methanidyl-2-methylpropane
CID 15914338
2-methanidyl-2-methylpropane;zinc;hydroiodide
CID 87657169
2-methylpropane;titanium(4+);trichloride
CID 162088142
ethane;2-methylpropane;yttrium
CID 167494260
magnesium;2-methanidyl-2-methylpropane;propane
CID 21463987
2,2-dimethanidylpropane;tetrakis(yttrium)
CID 58974122
CID 135427175
CID 135427175
cesium 2-methylpropane
CID 19086402

Frequently Asked Questions

What is the IUPAC name of bis(2-methanidyl-2-methylpropane);bis(2-methylpropane);bis(yttrium)?
The IUPAC name of bis(2-methanidyl-2-methylpropane);bis(2-methylpropane);bis(yttrium) (CID 165071362) is bis(2-methanidyl-2-methylpropane);bis(2-methylpropane);bis(yttrium).
What is the SMILES notation for bis(2-methanidyl-2-methylpropane);bis(2-methylpropane);bis(yttrium)?
The canonical SMILES for bis(2-methanidyl-2-methylpropane);bis(2-methylpropane);bis(yttrium) is C[C-](C)C.C[C-](C)C.[CH2-]C(C)(C)C.[CH2-]C(C)(C)C.[Y].[Y].
What is the InChIKey of bis(2-methanidyl-2-methylpropane);bis(2-methylpropane);bis(yttrium)?
The InChIKey is SJKCPHYJNYGIET-UHFFFAOYSA-N. The full InChI is InChI=1S/2C5H11.2C4H9.2Y/c2*1-5(2,3)4;2*1-4(2)3;;/h2*1H2,2-4H3;2*1-3H3;;/q4*-1;;.
What are the key properties of bis(2-methanidyl-2-methylpropane);bis(2-methylpropane);bis(yttrium)?
bis(2-methanidyl-2-methylpropane);bis(2-methylpropane);bis(yttrium) has a molecular weight of 434.33 g/mol, XLogP of 6.97, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for bis(2-methanidyl-2-methylpropane);bis(2-methylpropane);bis(yttrium) is sourced from PubChem (CID 165071362), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).